CID 143710

60558-96-5

Structural Information

Molecular Formula

C₁₁H₂₆N₂

SMILES

CCN(CC)CCCN(CC)CC

InChI

InChI=1S/C11H26N2/c1-5-12(6-2)10-9-11-13(7-3)8-4/h5-11H2,1-4H3

InChIKey

RCZLVPFECJNLMZ-UHFFFAOYSA-N

Compound name

N,N,N',N'-tetraethylpropane-1,3-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 2309
Patents: 186.2096 Da
Monoisotopic Mass: 2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	187.21688	150.6
[M+Na]+	209.19882	154.3
[M-H]-	185.20232	152.8
[M+NH4]+	204.24342	171.3
[M+K]+	225.17276	155.5
[M+H-H2O]+	169.20686	144.0
[M+HCOO]-	231.20780	175.7
[M+CH3COO]-	245.22345	199.2
[M+Na-2H]-	207.18427	153.8
[M]+	186.20905	154.7
[M]-	186.21015	154.7

Literature stripe

literature stripe

Patent stripe

patents stripe